CID 67742

Pentafluoropropionic anhydride

Structural Information

Molecular Formula
C6F10O3
SMILES
C(=O)(C(C(F)(F)F)(F)F)OC(=O)C(C(F)(F)F)(F)F
InChI
InChI=1S/C6F10O3/c7-3(8,5(11,12)13)1(17)19-2(18)4(9,10)6(14,15)16
InChIKey
XETRHNFRKCNWAJ-UHFFFAOYSA-N
Compound name
2,2,3,3,3-pentafluoropropanoyl 2,2,3,3,3-pentafluoropropanoate
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

85
References

2575
Patents

309.96878 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.97606 149.0
[M+Na]+ 332.95800 158.7
[M-H]- 308.96150 137.9
[M+NH4]+ 328.00260 163.0
[M+K]+ 348.93194 157.3
[M+H-H2O]+ 292.96604 137.8
[M+HCOO]- 354.96698 155.2
[M+CH3COO]- 368.98263 201.1
[M+Na-2H]- 330.94345 151.8
[M]+ 309.96823 135.6
[M]- 309.96933 135.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe